AB42972
494-52-0 | (S)-3-(Piperidin-2-yl)pyridine
Manufacturer: A2B Chem
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CatalogNumber
AB42972
ChemicalName
(S)-3-(Piperidin-2-yl)pyridine
CasNumber
494-52-0
MolecularFormula
C10H14N2
MolecularWeight
162.2316
MdlNumber
MFCD00871391
Smiles
C1CC[C@H](NC1)c1cccnc1
NscNumber
87504
Complexity
136
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
1
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CatalogNumber: AB42972
ChemicalName: (S)-3-(Piperidin-2-yl)pyridine
CasNumber: 494-52-0
MolecularFormula: C10H14N2
MolecularWeight: 162.2316
MdlNumber: MFCD00871391
Smiles: C1CC[C@H](NC1)c1cccnc1
NscNumber: 87504
Complexity: 136
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 1
CatalogNumber:
AB42972
ChemicalName:
(S)-3-(Piperidin-2-yl)pyridine
CasNumber:
494-52-0
MolecularFormula:
C10H14N2
MolecularWeight:
162.2316
MdlNumber:
MFCD00871391
Smiles:
C1CC[C@H](NC1)c1cccnc1
NscNumber:
87504
Complexity:
136
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCC(C(=O)C(=O)N1CCC[C@H]1C(=O)OCCCc1cccnc1)(C)C
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCC(C(=O)C(=O)N1CCC[C@H]1C(=O)OCCCc1cccnc1)(C)C
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB42974
ChemicalName: (S)-3-Butene-1,2-diol
CasNumber: 62214-39-5
MolecularFormula: C4H8O2
MolecularWeight: 88.1051
MdlNumber: MFCD00145261
Smiles: O[C@@H](C=C)CO
NscNumber: __
Complexity: 42.8
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 6
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 2
RotatableBondCount: 2
Xlogp3: -0.5
CatalogNumber:
AB42974
ChemicalName:
(S)-3-Butene-1,2-diol
CasNumber:
62214-39-5
MolecularFormula:
C4H8O2
MolecularWeight:
88.1051
MdlNumber:
MFCD00145261
Smiles:
O[C@@H](C=C)CO
NscNumber:
__
Complexity:
42.8
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
6
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
2
RotatableBondCount:
2
Xlogp3:
-0.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: ClC[C@@H]1CO1
NscNumber: __
Complexity: 37.9
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 0.5
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
ClC[C@@H]1CO1
NscNumber:
__
Complexity:
37.9
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
0.5